3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide

C20H19N3O3S — CID 142392099

IUPAC3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide
SMILESCNc1cc(C(=O)Nc2cccc(-c3ccccn3)c2)ccc1S(C)(=O)=O
InChIInChI=1S/C20H19N3O3S/c1-21-18-13-15(9-10-19(18)27(2,25)26)20(24)23-16-7-5-6-14(12-16)17-8-3-4-11-22-17/h3-13,21H,1-2H3,(H,23,24)
InChIKeyLKHSZFIDOFHTLD-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.45
Rot. Bonds5

About 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide

3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide (PubChem CID 142392099) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide
PubChem CID142392099
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC Name3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide
SMILESCNc1cc(C(=O)Nc2cccc(-c3ccccn3)c2)ccc1S(C)(=O)=O
InChIInChI=1S/C20H19N3O3S/c1-21-18-13-15(9-10-19(18)27(2,25)26)20(24)23-16-7-5-6-14(12-16)17-8-3-4-11-22-17/h3-13,21H,1-2H3,(H,23,24)
InChIKeyLKHSZFIDOFHTLD-UHFFFAOYSA-N
XLogP3.45
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-hydroxypropan-2-yl)-N-(3-pyridin-2-ylphenyl)benzamide
CID 142392143
1-(2-chloro-4-methylsulfonylphenyl)-3-(3-pyridin-2-ylphenyl)urea
CID 142392133
tert-butyl N-(3-pyridin-2-ylphenyl)carbamate
CID 53419021
N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108748438
4-phenyl-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108770359
5-chloro-N-(3-pyridin-2-ylphenyl)thiophene-2-carboxamide
CID 142392244
4-bromo-N-[3-(2-pyridin-2-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108748532
N-(3,5-dimethylphenyl)-4-pyridin-2-ylbenzamide
CID 143032339
N-[3-(methanesulfonamido)phenyl]-3-phenylbenzamide
CID 169152254
2-fluoro-6-[5-methylsulfonyl-2-[(3-pyridin-2-ylphenyl)carbamoyl]phenyl]benzamide
CID 70797434
4-methoxy-2-[5-methylsulfonyl-2-[(3-pyridin-2-ylphenyl)carbamoyl]phenyl]benzamide
CID 70797255
N-naphthalen-2-yl-4-pyridin-2-ylbenzamide
CID 59673032

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide?
The IUPAC name of 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide (CID 142392099) is 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide.
What is the SMILES notation for 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide?
The canonical SMILES for 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide is CNc1cc(C(=O)Nc2cccc(-c3ccccn3)c2)ccc1S(C)(=O)=O.
What is the InChIKey of 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide?
The InChIKey is LKHSZFIDOFHTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-21-18-13-15(9-10-19(18)27(2,25)26)20(24)23-16-7-5-6-14(12-16)17-8-3-4-11-22-17/h3-13,21H,1-2H3,(H,23,24).
What are the key properties of 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide?
3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide has a molecular weight of 381.46 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-4-methylsulfonyl-N-(3-pyridin-2-ylphenyl)benzamide is sourced from PubChem (CID 142392099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).